Vitas-M small molecule compound
2-{2-[(3-chlorophenyl)amino]-2-oxoethyl}-3-hydroxy-2H-1,4-benzothiazine-7-carboxylic acid
Catalog ID
STL155993
SMILES O=C(CC1Sc2cc(ccc2N=C1O)C(=O)O)Nc1cccc(c1)Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H13ClN2O4S MW 376.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN2O4S/c18-10-2-1-3-11(7-10)19-15(21)8-14-16(22)20-12-5-4-9(17(23)24)6-13(12)25-14/h1-7,14H,8H2,(H,19,21)(H,20,22)(H,23,24)InChIKey
PHOSOYPZBKZUAD-UHFFFAOYSA-NSynonyms
1282111-77-61282111776
2(2((3chlorophenyl)amino)2oxoethyl)3hydroxy2H14benzothiazine7carboxylicacid
2(2(3chloroanilino)2oxoethyl)3oxo4H14benzothiazine7carboxylicacid
C1=CC(=CC(=C1)Cl)NC(=O)CC2C(=O)NC3=C(S2)C=C(C=C3)C(=O)O
InChI=1SC17H13ClN2O4Sc181021311(710)1915(21)81416(22)2012549(17(23)24)613(12)2514h1714H8H2(H1921)(H2022)(H2324)
MFCD20757517
ZINC000061719252
ZINC000061719253
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